Home Carboxys Ethyl 1-methyl-7-oxo-4,5,6,7-tetrahydro-1h-indazole-3-carboxylate

Ethyl 1-methyl-7-oxo-4,5,6,7-tetrahydro-1h-indazole-3-carboxylate

CAS No.:
802541-13-5
Catalog Number:
AG005N9H
Molecular Formula:
C11H14N2O3
Molecular Weight:
222.2405
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$171
- +
1g
95%
1 week
United States
$373
- +
Product Description
Catalog Number:
AG005N9H
Chemical Name:
Ethyl 1-methyl-7-oxo-4,5,6,7-tetrahydro-1h-indazole-3-carboxylate
CAS Number:
802541-13-5
Molecular Formula:
C11H14N2O3
Molecular Weight:
222.2405
MDL Number:
MFCD16659087
IUPAC Name:
ethyl 1-methyl-7-oxo-5,6-dihydro-4H-indazole-3-carboxylate
InChI:
InChI=1S/C11H14N2O3/c1-3-16-11(15)9-7-5-4-6-8(14)10(7)13(2)12-9/h3-6H2,1-2H3
InChI Key:
CYKSYDSDCBBLQG-UHFFFAOYSA-N
SMILES:
Cn1nc(c2c1C(=O)CCC2)C(=O)OCC
Properties
Complexity:
306  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.1g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
222.244g/mol
Monoisotopic Mass:
222.1g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
61.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties